SMILES:
O=C(c1cc(Br)c(OCc2ccccc2)cc1OCc1ccccc1)N1Cc2ccccc2C1Molecular Processing
Molecular formula
C29H24BrNO3
Molecular weight
514.42
Exact mass
513.094
XLogP
6.76
TPSA
38.77
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
34
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.138
Molar refractivity
135.71
Supplementary Information
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